2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide

C16H17ClN2O — CID 9098705

IUPAC2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNc2ccccc2Cl)c1C
InChIInChI=1S/C16H17ClN2O/c1-11-6-5-9-14(12(11)2)19-16(20)10-18-15-8-4-3-7-13(15)17/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyLJXAGRYJRRIKQP-UHFFFAOYSA-N
MW288.78 g/mol
LogP4.01
Rot. Bonds4

About 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide

2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide (PubChem CID 9098705) has the molecular formula C16H17ClN2O and a molecular weight of 288.78 g/mol. Its IUPAC name is 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
PubChem CID9098705
Molecular FormulaC16H17ClN2O
Molecular Weight288.78 g/mol
Exact Mass288.10
IUPAC Name2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNc2ccccc2Cl)c1C
InChIInChI=1S/C16H17ClN2O/c1-11-6-5-9-14(12(11)2)19-16(20)10-18-15-8-4-3-7-13(15)17/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyLJXAGRYJRRIKQP-UHFFFAOYSA-N
XLogP4.01
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[[2-(2-chloroanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54810419
2-[(2-chlorophenyl)sulfonylamino]-N-(2,3-dimethylphenyl)acetamide
CID 26943189
N-[2-(2-chloroanilino)-2-oxoethyl]-2-(2,3-dimethylanilino)-N-methylacetamide
CID 26505954
2-(3,4-dichloroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 26416873
N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 33162844
N-(3-chloro-2-methylphenyl)-2-(2-fluoroanilino)acetamide
CID 2604427
N-[(2-chlorophenyl)methyl]-2-(2,3-dimethylanilino)acetamide
CID 26416416
N-(4-chloro-2-methylphenyl)-2-(2,3-dimethylanilino)acetamide
CID 7636870
N-(3-chloro-2-methylphenyl)-3-(2,3-dimethylanilino)propanamide
CID 109036028
N-[3-[[2-(3-chloro-2-methylanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54814911
N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2-(2,6-dimethylanilino)acetamide
CID 30706805
2-(5-chloro-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 2541105

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide?
The IUPAC name of 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide (CID 9098705) is 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide?
The canonical SMILES for 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide is Cc1cccc(NC(=O)CNc2ccccc2Cl)c1C.
What is the InChIKey of 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide?
The InChIKey is LJXAGRYJRRIKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O/c1-11-6-5-9-14(12(11)2)19-16(20)10-18-15-8-4-3-7-13(15)17/h3-9,18H,10H2,1-2H3,(H,19,20).
What are the key properties of 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide?
2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide has a molecular weight of 288.78 g/mol, XLogP of 4.01, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide is sourced from PubChem (CID 9098705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).